Compound Identification
SMILES
C[C@@H]1CN(C\C=C\C(=O)NC2=C(O[C@@H]3CCOC3)C=C3N=CN=C(NC4=CC(Cl)=C(F)C=C4)C3=C2)CC(=O)O1
InChIKey
InChIKey=YHDXPFVJAIHRAS-OTUKTJHOSA-N
Formula
C27H27ClFN5O5
Mass
555.99
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
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Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid esters
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Alpha amino acid esters
Alternative Parents
Quinazolinamines Phenol ethers N-arylamides Aniline and substituted anilines Chlorobenzenes Fluorobenzenes Alkyl aryl ethers Aminopyrimidines and derivatives Aryl fluorides Aryl chlorides Imidolactams Morpholines Heteroaromatic compounds Oxolanes Lactones Carboxylic acid esters Secondary carboxylic acid amides Trialkylamines Azacyclic compounds Dialkyl ethers Monocarboxylic acids and derivatives Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Quinazolinamine - Diazanaphthalene - Quinazoline - Phenol ether - Aniline or substituted anilines - N-arylamide - Alkyl aryl ether - Aminopyrimidine - Halobenzene - Fluorobenzene - Chlorobenzene - Morpholine - Oxazinane - Benzenoid - Imidolactam - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Pyrimidine - Aryl chloride - Heteroaromatic compound - Oxolane - Carboxamide group - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Lactone - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Ether - Dialkyl ether - Organoheterocyclic compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organohalogen compound - Organochloride - Organofluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available